SCHEMBL23705339

SCHEMBL23705339

C#CCNC(=O)CCC(O)C(NC(=O)COCCOCCOCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(O)CCC(=O)NCC#C

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.47
▸ POLB P06746 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.44
▸ KDM4E B2RXH2 1/20 0.42
▸ FOLH1 Q04609 9/20 0.41
▸ DGAT1 O75907 6/20 0.41
▸ KMT2A Q03164 1/20 0.40
▸ HCAR3 P49019 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23705733 0.86 MAPT (0.47) MAPTPOLBALDH1A1KDM4EFOLH1
SCHEMBL30064152 0.80 ALDH1A1 (0.55) MAPTPOLBALDH1A1KDM4EFOLH1
SCHEMBL27179319 0.78 FOLH1 (0.37) MAPTPOLBALDH1A1KDM4EFOLH1
SCHEMBL27179749 0.78 FOLH1 (0.36) MAPTPOLBALDH1A1KDM4EFOLH1
SCHEMBL27179367 0.76 FOLH1 (0.35) MAPTPOLBALDH1A1KDM4EFOLH1
SCHEMBL23705002 0.74 MAPT (0.49) MAPTPOLBALDH1A1KDM4EFOLH1
SCHEMBL23705230 0.74 FOLH1 (0.48) MAPTPOLBALDH1A1KDM4EFOLH1
SCHEMBL29184484 0.74 MAPT (0.48) MAPTPOLBALDH1A1KDM4EFOLH1
SCHEMBL27180242 0.73 ASGR1 (0.37) ALDH1A1FOLH1DGAT1
SCHEMBL563248 0.73 MAPT (0.62) MAPTPOLBALDH1A1KDM4EFOLH1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4097138-A1 ASGPR-BINDING COMPOUNDS FOR THE DEGRADATION OF EXTRACELLULAR PROTEINS Avila Therapeutics, Inc. (US) 2022-12-07 — — EP disclosed
WO-2021155317-A1 ASGPR-BINDING COMPOUNDS FOR THE DEGRADATION OF EXTRACELLULAR PROTEINS AVILAR THERAPEUTICS, INC. (US) 2021-08-05 — — WO disclosed
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